COMGENEX-ZINC06676097 MOE2007 3D Structure written by MMmdl. 53 56 0 0 1 0 0 0 0 0999 V2000 3.3440 6.3640 -2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 6.8770 -0.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 7.6810 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 7.9570 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 6.6410 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 5.8100 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 5.7330 -1.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 4.7150 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 3.3030 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 2.9070 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 1.6290 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 0.7240 -1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 1.0960 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.3800 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 2.7040 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 2.9320 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 3.2510 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 3.3350 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 3.0930 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 2.7760 1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 6.5610 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 6.4640 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 7.6170 -2.8150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8270 8.0500 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 7.0340 -4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 7.2770 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 8.5090 -3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6440 9.2460 -3.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 8.6910 -2.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 6.7090 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 6.7240 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 5.2720 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 7.9540 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 8.5260 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 4.8200 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 6.2800 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 4.8640 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 4.8860 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 3.6010 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 1.3390 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -0.2750 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.3660 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 2.8500 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 3.4220 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 3.5730 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.1420 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 2.5770 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 7.6030 -4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 5.9790 -4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 7.4530 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 6.4600 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 7.3180 0.2180 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2450 7.3280 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 52 2 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END